Compound Detail
CHEMBL147244
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Basic Information
| ChEMBL ID | CHEMBL147244 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HKKPLJLAWPXTAT-DGCLKSJQSA-N |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
307.2
MW (Da)
2.86
ALogP
2
HBA
1
HBD
28.3
PSA (Ų)
0.81
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 7.0
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Rattus norvegicus CHEMBL376 | IC50 | 7.0 | 7.0 | 100.0 | 1 |
| Dopamine receptor CHEMBL2093868 | IC50 | 6.0 | 6.0 | 1000.0 | 1 |
| Dopamine receptor CHEMBL2096970 | IC50 | 5.52 | 5.52 | 3000.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Rattus norvegicus | IC50 | = | 100.0 | nM | 7.0 | Inhibitory activity against prolactin release in rat anterior pituitary cells | 6834383 |
| Dopamine receptor | IC50 | = | 1000.0 | nM | 6.0 | In vitro binding affinity towards dopamine receptor was determined in rat striat... | 6834383 |
| Dopamine receptor | IC50 | = | 3000.0 | nM | 5.52 | In vitro binding affinity towards dopamine receptor was determined in bovine ant... | 6834383 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 6834383 | 10.1021/jm00358a012 | Rattus norvegicus | 5 |
| 6834383 | 10.1021/jm00358a012 | Dopamine receptor | 2 |
| 6834383 | 10.1021/jm00358a012 | Canis familiaris | 1 |
| 6834383 | 10.1021/jm00358a012 | Mus musculus | 1 |
Data from ChEMBL 36 via Core Engine